In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | Yes |
Popular Name: 2-[1-[[(3-cyano-2-pyridyl)amino]methyl]cyclohexyl]acetic 2-[1-[[(3-cyano-2-pyridyl)amino]…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.11 | 8.06 | -47.73 | 1 | 5 | -1 | 89 | 272.328 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.11 | 6.07 | -9.51 | 2 | 5 | 0 | 86 | 273.336 | 5 | ↓ |